3-chloranyl-2-undecan-2-yl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-chloranyl-2-undecan-2-yl-1H-1,2,4-triazol-5-one Openeye Name: 3-chloro-2-(1-methyldecyl)-1H-1,2,4-triazol-5-one CAS Name: 3-chloro-2-undecan-2-yl-1H-1,2,4-triazol-5-one IUPAC Name: 3-chloro-2-undecan-2-yl-1H-1,2,4-triazol-5-one Traditional Name: 3-chloro-2-(1-methyldecyl)-1H-1,2,4-triazol-5-one Formula: C13H24ClN3O MolecularWeight: 273.80216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)N1C(=NC(=O)N1)Cl

Isomeric SMILES

CCCCCCCCCC(C)N1C(=NC(=O)N1)Cl

InChI

InChI=1S/C13H24ClN3O/c1-3-4-5-6-7-8-9-10-11(2)17-12(14)15-13(18)16-17/h11H,3-10H2,1-2H3,(H,16,18)